3-[[1-(3-methoxyphenyl)-2-oxidanylidene-pentyl]amino]-5-phenyl-thiophene-2-carboxylic acid

Systemtic Name: 3-[[1-(3-methoxyphenyl)-2-oxidanylidene-pentyl]amino]-5-phenyl-thiophene-2-carboxylic acid Openeye Name: 3-[[1-(3-methoxyphenyl)-2-oxo-pentyl]amino]-5-phenyl-thiophene-2-carboxylic acid CAS Name: 3-[[1-(3-methoxyphenyl)-2-oxopentyl]amino]-5-phenyl-2-thiophenecarboxylic acid IUPAC Name: 3-[[1-(3-methoxyphenyl)-2-oxopentyl]amino]-5-phenylthiophene-2-carboxylic acid Traditional Name: 3-[[2-keto-1-(3-methoxyphenyl)pentyl]amino]-5-phenyl-2-thenoic acid Formula: C23H23NO4S MolecularWeight: 409.49802

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C(C1=CC(=CC=C1)OC)NC2=C(SC(=C2)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CCCC(=O)C(C1=CC(=CC=C1)OC)NC2=C(SC(=C2)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C23H23NO4S/c1-3-8-19(25)21(16-11-7-12-17(13-16)28-2)24-18-14-20(29-22(18)23(26)27)15-9-5-4-6-10-15/h4-7,9-14,21,24H,3,8H2,1-2H3,(H,26,27)